2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide

C17H13F2N3O — CID 135316122

IUPAC2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide
SMILESO=C(Cc1c(F)cccc1F)Nc1ccn(-c2ccccc2)n1
InChIInChI=1S/C17H13F2N3O/c18-14-7-4-8-15(19)13(14)11-17(23)20-16-9-10-22(21-16)12-5-2-1-3-6-12/h1-10H,11H2,(H,20,21,23)
InChIKeyWEJSSLBYFHNEIO-UHFFFAOYSA-N
MW313.31 g/mol
LogP3.33
Rot. Bonds4

About 2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide

2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide (PubChem CID 135316122) has the molecular formula C17H13F2N3O and a molecular weight of 313.31 g/mol. Its IUPAC name is 2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide
PubChem CID135316122
Molecular FormulaC17H13F2N3O
Molecular Weight313.31 g/mol
Exact Mass313.10
IUPAC Name2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide
SMILESO=C(Cc1c(F)cccc1F)Nc1ccn(-c2ccccc2)n1
InChIInChI=1S/C17H13F2N3O/c18-14-7-4-8-15(19)13(14)11-17(23)20-16-9-10-22(21-16)12-5-2-1-3-6-12/h1-10H,11H2,(H,20,21,23)
InChIKeyWEJSSLBYFHNEIO-UHFFFAOYSA-N
XLogP3.33
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.31
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-phenylpyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]acetamide
CID 135315885
2-(3-fluoro-4-methoxyphenyl)-N-(1-phenylpyrazol-3-yl)acetamide
CID 135315910
2-(1-methylpyrrol-2-yl)-N-(1-phenylpyrazol-3-yl)acetamide
CID 135315845
3-methyl-N-(1-phenylpyrazol-3-yl)butanamide
CID 110470740
2,5-difluoro-N-(1-phenylpyrazol-3-yl)benzamide
CID 47021837
2-(3,4-dimethoxyphenyl)-N-(1-phenylpyrazol-3-yl)acetamide
CID 135315862
1-(4-fluorophenyl)-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide
CID 135315796
1-(2-fluorophenyl)-2,2-dimethyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide
CID 135315834
4-(4-chlorophenyl)-N-(1-phenylpyrazol-3-yl)butanamide
CID 55775808
phenyl N-(1-phenylpyrazol-3-yl)carbamate
CID 110472459
3-(3-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide
CID 55547813
3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide
CID 55536355

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide?
The IUPAC name of 2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide (CID 135316122) is 2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide is O=C(Cc1c(F)cccc1F)Nc1ccn(-c2ccccc2)n1.
What is the InChIKey of 2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide?
The InChIKey is WEJSSLBYFHNEIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F2N3O/c18-14-7-4-8-15(19)13(14)11-17(23)20-16-9-10-22(21-16)12-5-2-1-3-6-12/h1-10H,11H2,(H,20,21,23).
What are the key properties of 2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide?
2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide has a molecular weight of 313.31 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluorophenyl)-N-(1-phenylpyrazol-3-yl)acetamide is sourced from PubChem (CID 135316122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).